SCHEMBL10425527

SCHEMBL10425527

Cc1ccc(C2=CO2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 4/20 0.47
TDP1 Q9NUW8 1/20 0.47
NPC1 O15118 3/20 0.38
RAB9A P51151 3/20 0.38
NFKB1 P19838 2/20 0.38
NFKB2 Q00653 2/20 0.38
RELA Q04206 2/20 0.38
HPGD P15428 2/20 0.38
NOTUM Q6P988 1/20 0.38
POLB P06746 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
LMNA P02545 1/20 0.38
PKM P14618 1/20 0.38
IDO1 P14902 1/20 0.38
ENPP3 O14638 1/20 0.37
ENPP1 P22413 1/20 0.37
KDM4E B2RXH2 1/20 0.37
NR1H4 Q96RI1 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL18661495 0.73 ACHE (0.73) ACHETDP1HPGDLMNAIDO1
SCHEMBL197731 0.73 ACHE (0.73) ACHETDP1HPGDLMNAIDO1
SCHEMBL3287696 0.73 ACHE (0.73) ACHETDP1HPGDLMNAIDO1
SCHEMBL28416692 0.71 CYP2A6 (0.47) NPC1RAB9AHPGDSMN1; SMN2LMNA
SCHEMBL9812881 0.71 NPC1 (0.44) ACHENPC1RAB9ANOTUMPOLB
SCHEMBL29571728 0.71 ESR1 (0.56) NPC1RAB9ANFKB1NFKB2RELA
Water SCHEMBL3680095 0.70 ACHE (0.67) ACHETDP1HPGDLMNAIDO1
SCHEMBL31591282 0.70 ACHE (0.67) ACHETDP1HPGDLMNAPKM
Water SCHEMBL3763584 0.70 ACHE (0.67) ACHETDP1HPGDLMNAIDO1
SCHEMBL31498547 0.70 ACHE (0.67) ACHETDP1HPGDNOTUMLMNA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104114682-A Use of quaternized alkylamines as additives in fuels and lubricants BASF SE 2014-10-22 CN disclosed
CN-1040211-A LOW VISCOSITY EPOXY RESIN COMPOSITIONS GEN ELECTRIC (US) 1990-03-07 CN disclosed
US-4906711-A Low viscosity epoxy resin compositions GENERAL ELECTRIC COMPANY (US) 1990-03-06 US disclosed
EP-0353103-A2 Low viscosity epoxy resin compositions GENERAL ELECTRIC COMPANY (US) 1990-01-31 EP disclosed